Geometry & MOs

Info

ID:	133276
PubChem CID:	51502774
Reduced:	FO2N3C20H32 (1)
Stoich.:	AB2C3D20E32 (1)
Weight, g/mol:	409.249118
ΔH_f, kcal/mol:	-99.7
Dipole, Da:	9.64
IP(EA), eV:	-7.67(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

1-[[1-(2-methoxyethyl)-2-methylindol-3-yl]methyl]-4-(2-methoxyphenyl)piperidin-1-ium-4-ol

Drug info:

PubChemData

Smile

C1CC[NH+](CC1)CC(=O)NCC[NH+]2CCC(CC2)(C3=CC=C(C=C3)F)O

DOS

IR

Vibrations